1UHC

Solution Structure of RSGI RUH-002, a SH3 Domain of KIAA1010 protein [Homo sapiens]


SOLUTION NMR
NMR Experiment
ExperimentTypeSample ContentsSolventIonic StrengthpHPressureTemperature (K)Spectrometer
13D_13C-separated_NOESY1mM RSGI RUH-002 U-15N, 13C; 20mM phosphate buffer Na; 100mM NaCl; 0.02% NaN3; 90% H2O, 10% D2O90% H2O/10% D2O100mM NaCl6.0ambient298
23D_15N-separated_NOESY1mM RSGI RUH-002 U-15N, 13C; 20mM phosphate buffer Na; 100mM NaCl; 0.02% NaN3; 90% H2O, 10% D2O90% H2O/10% D2O100mM NaCl6.0ambient298
NMR Spectrometer Information
SpectrometerManufacturerModelField Strength
1VarianINOVA800
NMR Refinement
MethodDetailsSoftware
simulated annealing, torsion angle dynamicsVNMR
NMR Ensemble Information
Conformer Selection Criteriastructures with the least restraint violations, structures with the lowest energy,target function
Conformers Calculated Total Number100
Conformers Submitted Total Number20
Representative Model1 (the structure with the lowest energy and score of target function was selected.)
Additional NMR Experimental Information
DetailsThe structure was determined using triple-resonance NMR spectroscopy.
Computation: NMR Software
#ClassificationVersionSoftware NameAuthor
1collectionVNMR6.1CVarian
2processingNMRPipe20020425Delaglio, F.
3data analysisNMRView5.0.4Johnson, B.A.
4data analysisKUJIRA0.816Kobayashi, N.
5refinementCYANA1.0.7Guentert, P